- InChI
- InChI=1S/C23H38ClNO/c1-3-5-7-9-11-13-19-25(20-14-12-10-8-6-4-2)23(26)21-15-17-22(24)18-16-21/h15-18H,3-14,19-20H2,1-2H3
- InChI Key
- MLJYWQWBEVWXDK-UHFFFAOYSA-N
- Formula
- C23H38ClNO
- SMILES
-
CCCCCCCCN(CCCCCCCC)C(=O)c1ccc(
Cl)cc1 - Molecular Weight1
- 380.01
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.0110 | Relay (1.0) Calculated Property | |
| ΔfG° | 215.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -438.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.40 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.37 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.503 | Crippen Calculated Property | |
| McVol | 334.960 | ml/mol | McGowan Calculated Property |
| Pc | 1050.05 | kPa | Joback Calculated Property |
| Inp | [2670.00; 2670.00] |
|
|
| Inp | 2670.00 | NIST | |
| Inp | 2670.00 | NIST | |
| Tboil | 668.90 | K | Relay (1.0) Calculated Property |
| Tc | 871.90 | K | Relay (1.0) Calculated Property |
| Tfus | 312.17 | K | Relay (1.0) Calculated Property |
| Vc | 1.245 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1049.53; 1144.57] | J/mol×K | [861.04; 1059.29] |
|
| Cp,gas | 1049.53 | J/mol×K | 861.04 | Joback Calculated Property |
| Cp,gas | 1067.88 | J/mol×K | 894.08 | Joback Calculated Property |
| Cp,gas | 1085.14 | J/mol×K | 927.12 | Joback Calculated Property |
| Cp,gas | 1101.37 | J/mol×K | 960.16 | Joback Calculated Property |
| Cp,gas | 1116.65 | J/mol×K | 993.20 | Joback Calculated Property |
| Cp,gas | 1131.02 | J/mol×K | 1026.24 | Joback Calculated Property |
| Cp,gas | 1144.57 | J/mol×K | 1059.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-dioctyl-4-chloro-.
Sources
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